1.0 2016-09-30 23:20:03 UTC 2020-04-22 15:16:49 UTC BMDB0006059 BMDB06059 20-Carboxyleukotriene B4 20-Carboxy-LTB4 20-COOH-Leukotriene b4 20-COOH-LTB4 5,12-Dihydroxy-delta5,8,11,14-eicosapolyendioic acid 5,12-Dihydroxy-delta5,8,11,14-eicosapolyendioate 5,12-Dihydroxy-δ5,8,11,14-eicosapolyendioate 5,12-Dihydroxy-δ5,8,11,14-eicosapolyendioic acid (5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxyicosa-6,8,10,14-tetraenedioate (5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxyicosa-6,8,10,14-tetraenedioic acid (S-(R*,s*-(e,Z,e,Z)))-5,12-dihydroxy-6,8,10,14-eicosatetraenedioate (S-(R*,s*-(e,Z,e,Z)))-5,12-dihydroxy-6,8,10,14-eicosatetraenedioic acid 20-Carboxy-leukotriene- b4 20-Carboxyleukotriene b4 20-Hydroxy-20-oxo-leukotriene b4 5(S),12(R)-Dihydroxy-20-carboxy-6,8,10,14-eicosatetraenoate 5(S),12(R)-Dihydroxy-20-carboxy-6,8,10,14-eicosatetraenoic acid 5S,12R-Dihydroxy-6Z,8E,10E,14Z-eicosatetraene-1,20-dioate 5S,12R-Dihydroxy-6Z,8E,10E,14Z-eicosatetraene-1,20-dioic acid 20-COOH LTB4 C20H30O6 366.4486 366.204238692 (5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenedioic acid 20-cooh-LTB4 80434-82-8 O[C@@H](CCCC(O)=O)\C=C/C=C/C=C/[C@H](O)C\C=C/CCCCC(O)=O InChI=1S/C20H30O6/c21-17(11-6-2-1-3-9-15-19(23)24)12-7-4-5-8-13-18(22)14-10-16-20(25)26/h2,4-8,12-13,17-18,21-22H,1,3,9-11,14-16H2,(H,23,24)(H,25,26)/b5-4+,6-2-,12-7+,13-8-/t17-,18-/m1/s1 SXWGPVJGNOLNHT-VFLUTPEKSA-N belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Long-chain fatty acids Carbonyl compounds Carboxylic acids Dicarboxylic acids and derivatives Hydrocarbon derivatives Hydroxy fatty acids Organic oxides Secondary alcohols Unsaturated fatty acids Alcohol Aliphatic acyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Dicarboxylic acid or derivatives Hydrocarbon derivative Hydroxy fatty acid Long-chain fatty acid Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Unsaturated fatty acid Aliphatic acyclic compounds Leukotrienes Leukotrienes icosatetraenedioic acid Solid logp 3.17 ALOGPS logs -3.91 ALOGPS logp 2.81 ChemAxon pka_strongest_acidic 4.33 ChemAxon pka_strongest_basic -1.3 ChemAxon iupac (5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenedioic acid ChemAxon average_mass 366.4486 ChemAxon mono_mass 366.204238692 ChemAxon smiles O[C@@H](CCCC(O)=O)\C=C/C=C/C=C/[C@H](O)C\C=C/CCCCC(O)=O ChemAxon formula C20H30O6 ChemAxon inchi InChI=1S/C20H30O6/c21-17(11-6-2-1-3-9-15-19(23)24)12-7-4-5-8-13-18(22)14-10-16-20(25)26/h2,4-8,12-13,17-18,21-22H,1,3,9-11,14-16H2,(H,23,24)(H,25,26)/b5-4+,6-2-,12-7+,13-8-/t17-,18-/m1/s1 ChemAxon inchikey SXWGPVJGNOLNHT-VFLUTPEKSA-N ChemAxon polar_surface_area 115.06 ChemAxon refractivity 104.65 ChemAxon polarizability 40.39 ChemAxon rotatable_bond_count 15 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Arachidonic Acid Metabolism SMP0087220 Specdb::MsMs 91185 Specdb::MsMs 91186 Specdb::MsMs 91187 Specdb::MsMs 154521 Specdb::MsMs 154522 Specdb::MsMs 154523 Specdb::MsMs 2742115 Specdb::MsMs 2742116 Specdb::MsMs 2742117 Specdb::MsMs 2939360 Specdb::MsMs 2939361 Specdb::MsMs 2939362 Specdb::CMs 19799 Specdb::CMs 38952 Specdb::CMs 151347 FDB112228 4444400 5280877 27562 C05950